COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL564669
Chemical Name: 6-(acetyloxy)-5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl2,3,4-tri-O-acetyl-beta-L-glucopyranosiduronicacid
Smiles: CC(=O)O[C@@H]1[C@H](O[C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)C(=O)O)Oc1cc2oc(cc(=O)c2c(c1OC(=O)C)O)c1ccccc1

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Molecular Weight: 614.52
Empirical Formula: C29H26O15

Physical State: Liquid
Available Amount: 74 mg

Lipinsky:
logP: 2.921
Rotatable bonds: 8
H-donors: 2
H-acceptors: 15
PSA: 207
Number of rings: 4

     

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